For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-[N,N-DI-(2-HYDROXYETHYL)-AMINO]-ETHYL-BETA-APO-8'-CAROTENOATE-HYDROBROMIDE
SpectraBase Compound ID 6ueQIu1F8aT
InChI InChI=1S/C36H53NO4.BrH/c1-29(15-10-16-31(3)20-21-34-32(4)19-12-22-36(34,6)7)13-8-9-14-30(2)17-11-18-33(5)35(40)41-28-25-37(23-26-38)24-27-39;/h8-11,13-18,20-21,38-39H,12,19,22-28H2,1-7H3;1H/b9-8+,15-10+,17-11+,21-20+,29-13+,30-14+,31-16+,33-18+;
InChIKey QCZWJZQFIDNISI-BRTNLUHOSA-N
Mol Weight 644.7 g/mol
Molecular Formula C36H54BrNO4
Exact Mass 643.323622 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7fG6PPlyohY
Name 2-[N,N-DI-(2-HYDROXYETHYL)-AMINO]-ETHYL-BETA-APO-8'-CAROTENOATE-HYDROBROMIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H54BrNO4
InChI InChI=1S/C36H53NO4.BrH/c1-29(15-10-16-31(3)20-21-34-32(4)19-12-22-36(34,6)7)13-8-9-14-30(2)17-11-18-33(5)35(40)41-28-25-37(23-26-38)24-27-39;/h8-11,13-18,20-21,38-39H,12,19,22-28H2,1-7H3;1H/b9-8+,15-10+,17-11+,21-20+,29-13+,30-14+,31-16+,33-18+;
InChIKey QCZWJZQFIDNISI-BRTNLUHOSA-N
Literature Reference Author M.D.PUNGENTE,E.JUBELI,C.L.OPSTAD,M.A.KAWAZ,N.BARAKAT,T.IBRAH IM,N.A.KHALIQUE,L.RA
Literature Reference Citation MOLECULES,17,3484(2012)
Literature Reference DOI 10.3390/molecules17033484
Molecular Weight 644.733 g/mol
Sample ID 1654
Solvent CDCl3